N-[(E)-(5-bromanyl-2,4-dimethoxy-phenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(5-bromanyl-2,4-dimethoxy-phenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-[(E)-(5-bromo-2,4-dimethoxy-phenyl)methyleneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: N-[(E)-(5-bromo-2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-(5-bromo-2,4-dimethoxyphenyl)methylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: N-[(E)-(5-bromo-2,4-dimethoxy-benzylidene)amino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C20H18BrN5O5 MolecularWeight: 488.29142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=NNC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-])Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=N/NC(=O)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C20H18BrN5O5/c1-30-18-10-19(31-2)16(21)9-14(18)11-22-23-20(27)17-7-8-25(24-17)12-13-3-5-15(6-4-13)26(28)29/h3-11H,12H2,1-2H3,(H,23,27)/b22-11+